N-Methylaniline hydrochloride

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H9N.ClH
Molecular Weight	143.614
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N-Methylaniline hydrochloride

Structure Search

SMILES

Cl.CNC1=CC=CC=C1

InChI

InChIKey=ZCXOSDRICFIHTA-UHFFFAOYSA-N

InChI=1S/C7H9N.ClH/c1-8-7-5-3-2-4-6-7;/h2-6,8H,1H3;1H

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C7H9N
Molecular Weight	107.1531
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Electrochemical degradation of crystal violet with BDD electrodes: effect of electrochemical parameters and identification of organic by-products.	2010-09	20709357
N,N-Dimethyl-4-[(2-pyrid-yl)diazen-yl]aniline.	2010-07-07	21588253
FTIR and FTRaman spectroscopic investigation of 2-bromo-4-methylaniline using ab initio HF and DFT calculations.	2010-06	20335064
Synthesis, characterization and cytotoxicity of iodo-bridged binuclear platinum(II) complexes.	2010-06	20153562
Self-structured surface patterns on molecular azo glass films induced by laser light irradiation.	2010-05-04	20000616
1,2-Diphenyl-2-(m-tolyl-amino)ethanone.	2010-04-17	21579159
Bis(N-{bis-[meth-yl(phen-yl)amino]phos-phor-yl}-2,2,2-trichloro-acetamide)di-nitrato-dioxidouranium(VI).	2010-02-17	21580248
Glycosidase inhibition: assessing mimicry of the transition state.	2010-01-21	20066263
Regional intravenous anesthesia in knee arthroscopy.	2010	21049208
N-{Bis[meth-yl(phen-yl)amino]phosphor-yl}-2,2,2-trichloro-acetamide.	2009-10-23	21578403
Mono- and binuclear complexes of rhodium involving a new series of hemilabile o-phosphinoaniline ligands.	2009-06-07	19452072
FT-IR, FT-Raman vibrational spectra and molecular structure investigation of 2-chloro-4-methylaniline: a combined experimental and theoretical study.	2009-06	19213598
Selective monomethylation of anilines by Cu(OAc)2-promoted cross-coupling with MeB(OH)2.	2009-04-16	19354317
Simultaneous determination of herbicide mefenacet and its metabolites residues in river water by solid phase extraction and rapid resolution liquid chromatography-mass spectrometry with pre-column derivatization.	2009-04-10	19223035
Direct amination of azoles via catalytic C-H, N-H coupling.	2009-04-02	19254040
Fourier transform infrared and FT-Raman spectra, assignment, ab initio, DFT and normal co-ordinate analysis of 2-chloro-4-methylaniline and 2-chloro-6-methylaniline.	2009-03	19081287
Glycogen synthase kinase-3 inhibition by 3-anilino-4-phenylmaleimides: insights from 3D-QSAR and docking.	2009-02	18839067
Theoretical study of N-dealkylation of N-cyclopropyl-N-methylaniline catalyzed by cytochrome P450: insight into the origin of the regioselectivity.	2009-01-14	19089010
Dipole effects on cation-pi interactions: absolute bond dissociation energies of complexes of alkali metal cations to N-methylaniline and N,N-dimethylaniline.	2008-09-04	18698747
Cavity-enhanced on-chip absorption spectroscopy using microring resonators.	2008-08-04	18679466
Electrochemical Investigation of oligonucleotide-DNA hybridization on poly(4-methoxyphenethylamine).	2008-06	19325797
Comparing the electronic properties and docking calculations of heme derivatives on CYP2B4.	2008-06	18478283
Cyclic nucleotide phosphodiesterase type 4 inhibitors: evaluation of pyrazolo[1,5-a]-1,3,5-triazine ring system as an adenine bioisostere.	2008-04	17640774
Efficient amide-directed catalytic asymmetric hydroboration.	2008-03-26	18311977
2,6-Di-tert-butyl-4-[(N-methyl-anilino)meth-yl]phenol.	2008-01-09	21201438
On the energy efficiency of microwave-assisted organic reactions.	2008	18605675
N-(substituted-anilinoethyl)amides: design, synthesis, and pharmacological characterization of a new class of melatonin receptor ligands.	2007-12-27	18052314
Influence of the d orbital occupation on the nature and strength of copper cation-pi interactions: threshold collision-induced dissociation and theoretical studies.	2007-11-28	17989799
Experimental and computational study of the thermochemistry of the fluoromethylaniline isomers.	2007-06-14	17518494
[Preweaning exposure to enriched environment induces hippocampal neurogenesis: experiment with rats].	2007-06-12	17785112
Fabrication and testing of planar chalcogenide waveguide integrated microfluidic sensor.	2007-03-05	19532465
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.	2006-11	16497524
Facile ring opening of 2,3-epoxy-steroids with aromatic amines in ionic liquids.	2006-08	16750547
Direct measurement of the thermodynamics of vinylarene hydroamination.	2006-07-26	16848446
Large Raman-scattering activities for the low-frequency modes of substituted benzenes: induced polarizability and stereo-specific ring-substituent interactions.	2006-03-14	16542073
Rate-limiting proton-transfer in the sigma-adduct forming reactions of 1,3,5-trinitrobenzene and 4-nitrobenzofuroxan with substituted anilines in dimethyl sulfoxide.	2005-11-07	16240016
Equilibrium and kinetic studies on the adsorption of aniline compounds from aqueous phase onto bifunctional polymeric adsorbent with sulfonic groups.	2005-10	16202803
Adsorption characteristics of aniline and 4-methylaniline onto bifunctional polymeric adsorbent modified by sulfonic groups.	2005-09-30	15927366
Noncatalytic mono-N-methylation of aniline in supercritical methanol: the kinetics and acid/base effect.	2005-08-21	16075087
Synthesis, dual fluorescence, and fluoroionophoric behavior of dipyridylaminomethylstilbenes.	2005-07-22	16018704
Ionization of aniline and its N-methyl and N-phenyl substituted derivatives by (free) electron transfer to n-butyl chloride parent radical cations.	2005-06-02	16833809
Distribution of amines in water/AOT/n-hexane reverse micelles: influence of the amine chemical structure.	2005-06-01	15848423
Prediction of genotoxicity of chemical compounds by statistical learning methods.	2005-06	15962942
Synthesis and photophysics of a porphyrin-fullerene dyad assembled through Watson-Crick hydrogen bonding.	2005-04-14	15795778
Influence of the water molecule on cation-pi interaction: ab initio second order Møller-Plesset perturbation theory (MP2) calculations.	2005-03-31	16851648
Effect of additives on photodegradation of 1,3,5-trichlorobenzene in aqueous surfactant solutions.	2005	15887570
Influence of the linker in bispyridium compounds on the inhibition of human choline kinase.	2004-10-21	15481981
Acidities of platinum(II) mu-hydroxo complexes bearing diphosphine ligands.	2004-10-18	15476378
Separation of positional isomers by cucurbit[7]uril-mediated capillary electrophoresis.	2004-10	15472950
Comparative nephrotoxicity of aspirin and phenacetin derivatives.	1971-11-27	5128205

Patents

Substance Class	Chemical Created by `admin` on `Tue Apr 01 17:40:45 GMT 2025` Edited by `admin` on `Tue Apr 01 17:40:45 GMT 2025`
Record UNII	423CWM3UKK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N-Methylanilinium chloride

Preferred Name

English

N-Methylaniline hydrochloride

Systematic Name

English

Benzenamine, N-methyl-, hydrochloride (1:1)

Systematic Name

English

Benzenamine, N-methyl-, hydrochloride

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID70181815